SCHEMBL5757645

SCHEMBL5757645

Cc1ccc(C(=O)NNc2ccc(C#N)cc2)c(=O)n1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ELANE P08246 16/20 0.54
CYP2C9 P11712 5/20 0.44
CYP3A4 P08684 3/20 0.44
NOTUM Q6P988 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
IDH1 O75874 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5756997 0.89 ELANE (0.58) ELANECYP2C9CYP3A4NOTUMRXFP1
SCHEMBL5758928 0.88 ELANE (0.57) ELANECYP2C9CYP3A4NOTUMALDH1A1
SCHEMBL5757787 0.88 ELANE (0.59) ELANENOTUMRXFP1ALDH1A1POLB
SCHEMBL5759333 0.87 ELANE (0.56) ELANENOTUMRXFP1ALDH1A1POLB
SCHEMBL5759697 0.87 ELANE (0.56) ELANECYP2C9CYP3A4NOTUMRXFP1
SCHEMBL5757746 0.85 ELANE (0.74) ELANECYP2C9
SCHEMBL5758842 0.85 ELANE (0.74) ELANENOTUMRXFP1ALDH1A1POLB
SCHEMBL5442962 0.83 ELANE (0.48) ELANECYP2C9CYP3A4RXFP1
SCHEMBL561046 0.78 NOTUM (0.68) ELANENOTUMALDH1A1POLBGAA
SCHEMBL5757554 0.78 ELANE (0.73) ELANE

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1562902-B1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE ASTRAZENECA AB (SE) 2006-05-03 EP disclosed
US-20060035938-A1 2-Pyridone derivatives as inhibitors of neutrophile elastase ASRAZENECA AB (SE) 2006-02-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060035938-A1 2-Pyridone derivatives as inhibitors of neutrophile elastase SERPINB1, ELANE, SERPINE1 ELANE 2/4885CYP2C9 1239/4885CYP3A4 560/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.